Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | RARA | P10276 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 1/20 | 0.35 |
| ▸ | RARG | P13631 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | PRKCA | P17252 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8329437 | 0.91 | MAPT (0.34) | KMT2ACYP3A4RARARARBRARG | |
| SCHEMBL6592969 | 0.77 | NPC1 (0.36) | KMT2ACYP3A4RARARARBRARG | |
| SCHEMBL6591370 | 0.73 | KMT2A (0.41) | KMT2ACYP3A4RARARARBRARG | |
| SCHEMBL7131831 | 0.70 | RARA (0.36) | KMT2ACYP3A4RARARARBRARG | |
| SCHEMBL1140980 | 0.70 | RARA (0.39) | KMT2ACYP3A4RARARARBRARG | |
| SCHEMBL727818 | 0.67 | CYP3A4 (0.46) | KMT2ACYP3A4RARARARBRARG | |
| SCHEMBL6591418 | 0.67 | RARA (0.46) | KMT2ACYP3A4RARARARBRARG | |
| SCHEMBL6591282 | 0.67 | MAPT (0.34) | KMT2ACYP3A4RARARARBRARG | |
| SCHEMBL8558273 | 0.66 | RARA (0.56) | KMT2ACYP3A4RARARARBRARG | |
| SCHEMBL9007075 | 0.66 | RARB (0.49) | KMT2ACYP3A4RARARARBRARG |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5958954-A | 2,2-DIALKYL-4-ARYL-SUBSTITUTED BENZOPYRAN AND BENZOTHIOPYRAN DERIVATIVES | ALLERGAN SALES, INC. (US) | 1999-09-28 | — | — | US | disclosed |